1-ethyl-N-methylpyrazole-3-carboxamide

C7H11N3O — CID 17144537

IUPAC1-ethyl-N-methylpyrazole-3-carboxamide
SMILESCCn1ccc(C(=O)NC)n1
InChIInChI=1S/C7H11N3O/c1-3-10-5-4-6(9-10)7(11)8-2/h4-5H,3H2,1-2H3,(H,8,11)
InChIKeySEUQSBACHHGNRF-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.26
Rot. Bonds2

About 1-ethyl-N-methylpyrazole-3-carboxamide

1-ethyl-N-methylpyrazole-3-carboxamide (PubChem CID 17144537) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is 1-ethyl-N-methylpyrazole-3-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-methylpyrazole-3-carboxamide
PubChem CID17144537
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC Name1-ethyl-N-methylpyrazole-3-carboxamide
SMILESCCn1ccc(C(=O)NC)n1
InChIInChI=1S/C7H11N3O/c1-3-10-5-4-6(9-10)7(11)8-2/h4-5H,3H2,1-2H3,(H,8,11)
InChIKeySEUQSBACHHGNRF-UHFFFAOYSA-N
XLogP0.26
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-methylpyrazole-3-carboxamide?
The IUPAC name of 1-ethyl-N-methylpyrazole-3-carboxamide (CID 17144537) is 1-ethyl-N-methylpyrazole-3-carboxamide.
What is the SMILES notation for 1-ethyl-N-methylpyrazole-3-carboxamide?
The canonical SMILES for 1-ethyl-N-methylpyrazole-3-carboxamide is CCn1ccc(C(=O)NC)n1.
What is the InChIKey of 1-ethyl-N-methylpyrazole-3-carboxamide?
The InChIKey is SEUQSBACHHGNRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-3-10-5-4-6(9-10)7(11)8-2/h4-5H,3H2,1-2H3,(H,8,11).
What are the key properties of 1-ethyl-N-methylpyrazole-3-carboxamide?
1-ethyl-N-methylpyrazole-3-carboxamide has a molecular weight of 153.18 g/mol, XLogP of 0.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-methylpyrazole-3-carboxamide is sourced from PubChem (CID 17144537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).